[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C18H12BrNO6 MolecularWeight: 418.19498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C[N+](=O)[O-])OC(=O)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])OC(=O)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C18H12BrNO6/c1-24-16-8-11(6-7-20(22)23)2-4-15(16)26-18(21)17-10-12-9-13(19)3-5-14(12)25-17/h2-10H,1H3/b7-6+